3-(1H-indol-3-yl)-2-[[(2S)-5-oxidanylidenepyrrolidin-2-yl]carbonylamino]propanoic acid

Systemtic Name: 3-(1H-indol-3-yl)-2-[[(2S)-5-oxidanylidenepyrrolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-(1H-indol-3-yl)-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]propanoic acid CAS Name: 3-(1H-indol-3-yl)-2-[[oxo-[(2S)-5-oxo-2-pyrrolidinyl]methyl]amino]propanoic acid IUPAC Name: 3-(1H-indol-3-yl)-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]propanoic acid Traditional Name: 3-(1H-indol-3-yl)-2-[[(2S)-5-ketoprolyl]amino]propionic acid Formula: C16H17N3O4 MolecularWeight: 315.32388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC1C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O

Isomeric SMILES

C1CC(=O)N[C@@H]1C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C16H17N3O4/c20-14-6-5-12(18-14)15(21)19-13(16(22)23)7-9-8-17-11-4-2-1-3-10(9)11/h1-4,8,12-13,17H,5-7H2,(H,18,20)(H,19,21)(H,22,23)/t12-,13?/m0/s1